(4E)-4-(5-methyl-4-phenyl-1,2-dihydropyrazol-3-ylidene)-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-(5-methyl-4-phenyl-1,2-dihydropyrazol-3-ylidene)-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-3-hydroxy-4-(5-methyl-4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,5-dien-1-one CAS Name: (4E)-3-hydroxy-4-(5-methyl-4-phenyl-1,2-dihydropyrazol-3-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-3-hydroxy-4-(5-methyl-4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4E)-3-hydroxy-4-(5-methyl-4-phenyl-3-pyrazolin-3-ylidene)cyclohexa-2,5-dien-1-one Formula: C16H14N2O2 MolecularWeight: 266.29456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC(=O)C=C2O)NN1)C3=CC=CC=C3

Isomeric SMILES

CC1=C(/C(=C\2/C=CC(=O)C=C2O)/NN1)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O2/c1-10-15(11-5-3-2-4-6-11)16(18-17-10)13-8-7-12(19)9-14(13)20/h2-9,17-18,20H,1H3/b16-13+